N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-propan-2-yl-benzimidazol-5-yl]-2-(4-methylphenoxy)ethanamide

Systemtic Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-propan-2-yl-benzimidazol-5-yl]-2-(4-methylphenoxy)ethanamide Openeye Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-isopropyl-benzimidazol-5-yl]-2-(4-methylphenoxy)acetamide CAS Name: N-[2-[(4-ethyl-1-piperazin-4-iumyl)methyl]-1-propan-2-yl-5-benzimidazolyl]-2-(4-methylphenoxy)acetamide IUPAC Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-propan-2-ylbenzimidazol-5-yl]-2-(4-methylphenoxy)acetamide Traditional Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-isopropyl-benzimidazol-5-yl]-2-(4-methylphenoxy)acetamide Formula: C26H36N5O2+ MolecularWeight: 450.59634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=NC3=C(N2C(C)C)C=CC(=C3)NC(=O)COC4=CC=C(C=C4)C

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=NC3=C(N2C(C)C)C=CC(=C3)NC(=O)COC4=CC=C(C=C4)C

InChI

InChI=1S/C26H35N5O2/c1-5-29-12-14-30(15-13-29)17-25-28-23-16-21(8-11-24(23)31(25)19(2)3)27-26(32)18-33-22-9-6-20(4)7-10-22/h6-11,16,19H,5,12-15,17-18H2,1-4H3,(H,27,32)/p+1